methyl 3-[(4-aminocarbonylpiperidin-1-yl)carbothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-aminocarbonylpiperidin-1-yl)carbothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-carbamoylpiperidine-1-carbothioyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(4-carbamoyl-1-piperidinyl)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-carbamoylpiperidine-1-carbothioyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(4-carbamoylpiperidine-1-carbothioyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C13H17N3O3S2 MolecularWeight: 327.42238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=S)N2CCC(CC2)C(=O)N

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=S)N2CCC(CC2)C(=O)N

InChI

InChI=1S/C13H17N3O3S2/c1-19-12(18)10-9(4-7-21-10)15-13(20)16-5-2-8(3-6-16)11(14)17/h4,7-8H,2-3,5-6H2,1H3,(H2,14,17)(H,15,20)